CAS 162257-99-0 | L-Threonine, N-[N-[N2-[N-[N-[N-[N-[N-[N2-[N2-(N-L-histidyl-L-seryl)-L-arginyl]-L-asparaginyl]-L-seryl]-L-isoleucyl]-L-threonyl]-L-leucyl]-L-threonyl]-L-asparaginyl]-L-leucyl]- (9CI) | CAS Number 162257-99-0

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162257-99-0 | L-Threonine, N-[N-[N2-[N-[N-[N-[N-[N-[N2-[N2-(N-L-histidyl-L-seryl)-L-arginyl]-L-asparaginyl]-L-seryl]-L-isoleucyl]-L-threonyl]-L-leucyl]-L-threonyl]-L-asparaginyl]-L-leucyl]- (9CI)

CAS No: 162257-99-0 Catalog No: AG001SXR MDL No:

Product Description

Catalog Number:

AG001SXR

Chemical Name:

L-Threonine, N-[N-[N2-[N-[N-[N-[N-[N-[N2-[N2-(N-L-histidyl-L-seryl)-L-arginyl]-L-asparaginyl]-L-seryl]-L-isoleucyl]-L-threonyl]-L-leucyl]-L-threonyl]-L-asparaginyl]-L-leucyl]- (9CI)

CAS Number:

162257-99-0

Molecular Formula:

C56H97N19O20

Molecular Weight:

1356.4847

IUPAC Name:

(2S,3R)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S,3R)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-4-oxobutanoyl]amino]-3-hydroxypropanoyl]amino]-3-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]-4-oxobutanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxybutanoic acid

InChI:

InChI=1S/C56H97N19O20/c1-10-25(6)40(72-51(90)37(21-77)71-47(86)34(17-38(58)81)67-45(84)31(12-11-13-63-56(60)61)65-50(89)36(20-76)70-44(83)30(57)16-29-19-62-22-64-29)52(91)74-42(27(8)79)54(93)68-33(15-24(4)5)48(87)73-41(26(7)78)53(92)69-35(18-39(59)82)46(85)66-32(14-23(2)3)49(88)75-43(28(9)80)55(94)95/h19,22-28,30-37,40-43,76-80H,10-18,20-21,57H2,1-9H3,(H2,58,81)(H2,59,82)(H,62,64)(H,65,89)(H,66,85)(H,67,84)(H,68,93)(H,69,92)(H,70,83)(H,71,86)(H,72,90)(H,73,87)(H,74,91)(H,75,88)(H,94,95)(H4,60,61,63)/t25-,26+,27+,28+,30-,31-,32-,33-,34-,35-,36-,37-,40-,41-,42-,43-/m0/s1

InChI Key:

KKWIXNMQTTUKIL-KIUKBXSCSA-N

SMILES:

CC[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)CC(C)C)CC(=O)N)[C@H](O)C)CC(C)C)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)N)CO)CCCNC(=N)N)CC(=O)N)CO)C